1-[2,5-bis(chloranyl)phenyl]-3-(pyridin-3-ylcarbamothioylamino)thiourea

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]-3-(pyridin-3-ylcarbamothioylamino)thiourea Openeye Name: 1-(2,5-dichlorophenyl)-3-(3-pyridylcarbamothioylamino)thiourea CAS Name: 1-[[(2,5-dichloroanilino)-sulfanylidenemethyl]amino]-3-(3-pyridinyl)thiourea IUPAC Name: 1-(2,5-dichlorophenyl)-3-(pyridin-3-ylcarbamothioylamino)thiourea Traditional Name: 1-(2,5-dichlorophenyl)-3-(3-pyridylthiocarbamoylamino)thiourea Formula: C13H11Cl2N5S2 MolecularWeight: 372.29594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=S)NNC(=S)NC2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

C1=CC(=CN=C1)NC(=S)NNC(=S)NC2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C13H11Cl2N5S2/c14-8-3-4-10(15)11(6-8)18-13(22)20-19-12(21)17-9-2-1-5-16-7-9/h1-7H,(H2,17,19,21)(H2,18,20,22)